ethyl 6-tert-butyl-2-[(2,4-diethoxyphenyl)carbonylamino]-1-benzothiophene-3-carboxylate

Systemtic Name: ethyl 6-tert-butyl-2-[(2,4-diethoxyphenyl)carbonylamino]-1-benzothiophene-3-carboxylate Openeye Name: ethyl 6-tert-butyl-2-[(2,4-diethoxybenzoyl)amino]benzothiophene-3-carboxylate CAS Name: 6-tert-butyl-2-[[(2,4-diethoxyphenyl)-oxomethyl]amino]-1-benzothiophene-3-carboxylic acid ethyl ester IUPAC Name: ethyl 6-tert-butyl-2-[(2,4-diethoxybenzoyl)amino]-1-benzothiophene-3-carboxylate Traditional Name: 6-tert-butyl-2-[(2,4-diethoxybenzoyl)amino]benzothiophene-3-carboxylic acid ethyl ester Formula: C26H31NO5S MolecularWeight: 469.59304

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=C(C=C1)C(=O)NC2=C(C3=C(S2)C=C(C=C3)C(C)(C)C)C(=O)OCC)OCC

Isomeric SMILES

CCOC1=CC(=C(C=C1)C(=O)NC2=C(C3=C(S2)C=C(C=C3)C(C)(C)C)C(=O)OCC)OCC

InChI

InChI=1S/C26H31NO5S/c1-7-30-17-11-13-18(20(15-17)31-8-2)23(28)27-24-22(25(29)32-9-3)19-12-10-16(26(4,5)6)14-21(19)33-24/h10-15H,7-9H2,1-6H3,(H,27,28)